Publication & Citation Trends
Most Cited Works
Publications
174 total
Constant-pH molecular dynamics simulations of progressive activation in a proton-gated ion channel OA
Cited by 1
Semantic Scholar
Near-wall depletion and layering affect contact line friction of multicomponent liquids OA
Cited by 1
Semantic Scholar
On the Path to Optimal Alchemistry OA
Cited by 3
Semantic Scholar
Scalable Constant pH Molecular Dynamics in GROMACS OA
Cited by 128
Semantic Scholar
Predictions of Skin Permeability Using Molecular Dynamics Simulation from Two-Dimensional Sampling of Spatial and Alchemical Perturbation Reaction Coordinates OA
Cited by 1
Semantic Scholar
Constant-Ph molecular dynamics simulations of a proton-gated ion channel OA
Cited by 0
Semantic Scholar
Skin permeability prediction with MD simulation sampling spatial and alchemical reaction coordinates OA
Cited by 12
Semantic Scholar
Best Practices in Constant pH MD Simulations: Accuracy and Sampling OA
Cited by 64
Semantic Scholar
Research Topics
Protein Structure and Dynamics
(35)
Spectroscopy and Quantum Chemical Studies
(32)
Advanced Chemical Physics Studies
(26)
Mass Spectrometry Techniques and Applications
(17)
nanoparticles nucleation surface interactions
(13)
Frequent Co-Authors
Affiliations
University of Siena
Goethe University Frankfurt
Nordic Institute for Theoretical Physics
SIB Swiss Institute of Bioinformatics
Oak Ridge National Laboratory